2-chloro-5-[5-({2-[2-(methoxycarbonyl)anilino]-2-oxoethyl}sulfanyl)-1H-tetrazol-1-yl]benzoic acid
Chemical Structure Depiction of
2-chloro-5-[5-({2-[2-(methoxycarbonyl)anilino]-2-oxoethyl}sulfanyl)-1H-tetrazol-1-yl]benzoic acid
2-chloro-5-[5-({2-[2-(methoxycarbonyl)anilino]-2-oxoethyl}sulfanyl)-1H-tetrazol-1-yl]benzoic acid
Compound characteristics
| Compound ID: | 8014-7819 |
| Compound Name: | 2-chloro-5-[5-({2-[2-(methoxycarbonyl)anilino]-2-oxoethyl}sulfanyl)-1H-tetrazol-1-yl]benzoic acid |
| Molecular Weight: | 447.85 |
| Molecular Formula: | C18 H14 Cl N5 O5 S |
| Smiles: | COC(c1ccccc1NC(CSc1nnnn1c1ccc(c(c1)C(O)=O)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7932 |
| logD: | -2.2424 |
| logSw: | -3.519 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 111.922 |
| InChI Key: | BJFRPEURJMBMTO-UHFFFAOYSA-N |